N-[4-bromanyl-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-2,5-dimethoxy-benzenesulfonamide

Systemtic Name: N-[4-bromanyl-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-2,5-dimethoxy-benzenesulfonamide Openeye Name: N-[4-bromo-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-2,5-dimethoxy-benzenesulfonamide CAS Name: N-[4-bromo-1-[(3,4-dichlorophenyl)methyl]-3-pyrazolyl]-2,5-dimethoxybenzenesulfonamide IUPAC Name: N-[4-bromo-1-[(3,4-dichlorophenyl)methyl]pyrazol-3-yl]-2,5-dimethoxybenzenesulfonamide Traditional Name: N-[4-bromo-1-(3,4-dichlorobenzyl)pyrazol-3-yl]-2,5-dimethoxy-benzenesulfonamide Formula: C18H16BrCl2N3O4S MolecularWeight: 521.21234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)S(=O)(=O)NC2=NN(C=C2Br)CC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)OC)S(=O)(=O)NC2=NN(C=C2Br)CC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C18H16BrCl2N3O4S/c1-27-12-4-6-16(28-2)17(8-12)29(25,26)23-18-13(19)10-24(22-18)9-11-3-5-14(20)15(21)7-11/h3-8,10H,9H2,1-2H3,(H,22,23)